SCHEMBL11277709

SCHEMBL11277709

CCCCOc1ccc(CCCC2(C(=O)OCC)CO2)cc1

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.67
MAPK1 P28482 2/20 0.67
ABCB11 O95342 1/20 0.67
MAPT P10636 1/20 0.67
S1PR1 P21453 1/20 0.46
ALDH1A1 P00352 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
MEN1 O00255 1/20 0.42
USP2 O75604 1/20 0.42
CYP3A4 P08684 1/20 0.42
CASP1 P29466 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
SLCO1B3 Q9NPD5 1/20 0.42
SLCO1B1 Q9Y6L6 1/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL11287515 0.91 MAPK1 (0.75) LMNAMAPK1ABCB11MAPTMEN1
SCHEMBL11263317 0.89 ABCB11 (0.65) LMNAMAPK1ABCB11MAPTALDH1A1
SCHEMBL11276195 0.88 LMNA (0.57) LMNAMAPK1ABCB11MAPTALDH1A1
SCHEMBL11272380 0.86 LMNA (0.54) LMNAMAPK1ABCB11MAPTALDH1A1
SCHEMBL11264433 0.84 LMNA (0.68) LMNAMAPK1ABCB11MAPTALDH1A1
SCHEMBL11288224 0.84 MAPT (0.80) LMNAMAPK1ABCB11MAPTL3MBTL1
SCHEMBL11271864 0.84 LMNA (0.52) LMNAMAPK1ABCB11MAPTALDH1A1
SCHEMBL11265171 0.83 LMNA (0.54) LMNAMAPK1ABCB11MAPTALDH1A1
SCHEMBL11267391 0.83 LMNA (0.61) LMNAMAPK1ABCB11MAPTALDH1A1
SCHEMBL14769764 0.82 MAPT (0.82) LMNAMAPK1ABCB11MAPTL3MBTL1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4324796-A HYPOGLYCEMIC AGENTS, HYPOKETONEMIC AGENTS BYK GULDEN LOMBERG CHEMISCHE FABRIK GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1982-04-13 US disclosed